AC1M0QRN structure

AC1M0QRN

2-[(7-benzylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide

Also Known As: 2-((5-(benzylthio)-8,9,10,11-tetrahydrobenzo[4,5]thieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl)thio)-N-(thiazol-2-yl)acetamide|2-{[5-(benzylsulfanyl)-8,9,10,11-tetrahydro[1]benzothieno[3,2-e][1,2,4]triazolo[4,3-c]pyrimidin-3-yl]sulfanyl}-N-(1,3-thiazol-2-yl)acetamide

CAS: 848754-45-0
Molecular Formula C23H20N6OS4
Molecular Weight 524.05817 g/mol
LogP 5.6974
Topological Polar Surface Area 85.07 Ų
Hydrogen Bond Donors 1
Hydrogen Bond Acceptors 9
Rotatable Bonds 7
Exact Mass 524.05817
Monoisotopic Mass 524.05817
Heavy Atoms 34
Complexity 1461.7167

Chemical Identifiers

CAS Number 848754-45-0
SMILES C1CCC2=C(C1)C3=C(S2)N=C(N4C3=NN=C4SCC(=O)NC5=NC=CS5)SCC6=CC=CC=C6

Product Overview

AC1M0QRN (CAS 848754-45-0), with molecular formula C23H20N6OS4 and molecular weight 524.05817 g/mol. IUPAC: 2-[(7-benzylsulfanyl-10-thia-3,4,6,8-tetrazatetracyclo[7.7.0.02,6.011,16]hexadeca-1(9),2,4,7,11(16)-pentaen-5-yl)sulfanyl]-N-(1,3-thiazol-2-yl)acetamide.

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